Information card for entry 2100768

Structure parameters

• Formula: C5 H15 Ca Cl2 N O4
• Calculated formula: C H2 Ca0.25 Cl0.25 N0.25 O0.75
• Title of publication: Structural analysis of the fourfold phase of betaine calcium chloride dihydrate at 90 K
• Authors of publication: Ezpeleta, J. M.; Zúñiga, F. J.; Pérez-Mato, J. M.; Paciorek, W. A.; Breczewski, T.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 1992
• Journal volume: 48
• Journal issue: 3
• Pages of publication: 261 - 269
• a: 10.894 ± 0.002 Å
• b: 10.013 ± 0.001 Å
• c: 43.237 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4716 ± 1 ų
• Number of distinct elements: 6
• Hermann-Mauguin space group symbol: P 21 c a
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: Mo
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No